N3-[2,3-bis(oxidanyl)propyl]-N1-(2-hydroxyethyl)-2,4,6-tris(iodanyl)-5-[methyl(2-oxidanylethanoyl)amino]benzene-1,3-dicarboxamide

Systemtic Name: N3-[2,3-bis(oxidanyl)propyl]-N1-(2-hydroxyethyl)-2,4,6-tris(iodanyl)-5-[methyl(2-oxidanylethanoyl)amino]benzene-1,3-dicarboxamide Openeye Name: N3-(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-methyl-amino]-N1-(2-hydroxyethyl)-2,4,6-triiodo-benzene-1,3-dicarboxamide CAS Name: N3-(2,3-dihydroxypropyl)-N1-(2-hydroxyethyl)-5-[(2-hydroxy-1-oxoethyl)-methylamino]-2,4,6-triiodobenzene-1,3-dicarboxamide IUPAC Name: 3-N-(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-methylamino]-1-N-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide Traditional Name: N'-glyceryl-5-[glycoloyl(methyl)amino]-N-(2-hydroxyethyl)-2,4,6-triiodo-isophthalamide Formula: C16H20I3N3O7 MolecularWeight: 747.05931

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCCO)I)C(=O)CO

Isomeric SMILES

CN(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCCO)I)C(=O)CO

InChI

InChI=1S/C16H20I3N3O7/c1-22(8(27)6-25)14-12(18)9(15(28)20-2-3-23)11(17)10(13(14)19)16(29)21-4-7(26)5-24/h7,23-26H,2-6H2,1H3,(H,20,28)(H,21,29)